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125314-92-3 | 1H-Pyrrole-2,5-dione, 3-bromo-4-(1H-indol-3-yl)-
CAS No: 125314-92-3 Catalog No: AG000NHF MDL No:
Product Description
Catalog Number:
AG000NHF
Chemical Name:
1H-Pyrrole-2,5-dione, 3-bromo-4-(1H-indol-3-yl)-
CAS Number:
125314-92-3
Molecular Formula:
C12H7BrN2O2
Molecular Weight:
291.1002
IUPAC Name:
3-bromo-4-(1H-indol-3-yl)pyrrole-2,5-dione
InChI:
InChI=1S/C12H7BrN2O2/c13-10-9(11(16)15-12(10)17)7-5-14-8-4-2-1-3-6(7)8/h1-5,14H,(H,15,16,17)
InChI Key:
WEAJGGMVHAWSNO-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(=C1c1c[nH]c2c1cccc2)Br
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.969g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
291.104g/mol
Monoisotopic Mass:
289.969g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| 3-Bromo-4-(1H-3-indolyl)-2,5-dihydro-1H-2,5-pyrroledione derivatives as new lead compounds for antibacterially active substances. | European journal of medicinal chemistry 20060201 |
| Strong fluorescence enhancement of 2-bromo-3-(1H-indol-3-yl)maleimide upon coordination to a Lewis-acidic metal complex. | Chemical communications (Cambridge, England) 20020407 |
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